PUBCHEM-ZINC00004594 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 0.4100 1.4040 0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 0.0890 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 -0.9660 1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 0.3870 -0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7120 1.5000 -1.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -0.4010 -1.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -0.6150 -0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 -1.0570 -2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -0.5750 -3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 0.3880 -4.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 0.5830 -5.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 -0.1650 -6.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2770 -1.1290 -5.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 -1.3120 -4.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 -2.1580 -3.5350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 -2.0080 -2.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8940 -3.1720 -3.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2450 -2.5850 -4.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9060 -1.7390 -3.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1710 -1.2280 -3.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7950 -1.5650 -4.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1550 -2.4140 -5.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8890 -2.9240 -5.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 1.2380 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 2.1030 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 1.8920 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -0.6940 1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -1.9470 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -1.0940 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 0.3130 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -1.3740 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 0.9640 -3.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 1.3210 -5.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 0.0000 -7.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9360 -1.7090 -6.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 -3.8840 -3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 -3.7160 -4.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4380 -1.4690 -2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6710 -0.5700 -2.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7810 -1.1700 -5.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6450 -2.6830 -6.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4110 -3.5910 -6.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 -0.5210 -0.4680 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 43 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 16 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 M CHG 1 43 -1 M END